| SpectraBase Spectrum ID |
49QLL2IUxO9 |
| Name |
16,17-seco-3-Methoxyestra-1,3,5(10)-trien-17-al-(p-Nitrophenyl)-hydrazone |
| Alternate Name(s) |
N-[(E)-[(1S,2S,4aS,10aR)-7-methoxy-2-methyl-1-propyl-3,4,4a,9,10,10a-hexahydro-1H-phenanthren-2-yl]methylideneamino]-4-nitroaniline
N-[(E)-[(1S,2S,4aS,10aR)-7-methoxy-2-methyl-1-propyl-3,4,4a,9,10,10a-hexahydro-1H-phenanthren-2-yl]methyleneamino]-4-nitro-aniline
N-[(E)-[(1S,2S,4aS,10aR)-7-methoxy-2-methyl-1-propyl-3,4,4a,9,10,10a-hexahydro-1H-phenanthren-2-yl]methylideneamino]-4-nitro-aniline |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H33N3O3 |
| InChI |
InChI=1S/C26H33N3O3/c1-4-5-25-24-12-6-18-16-21(32-3)11-13-22(18)23(24)14-15-26(25,2)17-27-28-19-7-9-20(10-8-19)29(30)31/h7-11,13,16-17,23-25,28H,4-6,12,14-15H2,1-3H3/b27-17+/t23-,24-,25+,26-/m1/s1 |
| InChIKey |
GKIJFSBBAONPKL-KHUDUMTFSA-N |
| Molecular Weight |
435.568 g/mol |
| SMILES |
N(\N=C\[C@@]1([C@]([C@@]2(CCc3c([C@]2(CC1)[H])ccc(OC)c3)[H])(CCC)[H])C)c1ccc(N(=O)=O)cc1 |
| SPLASH |
splash10-000b-0090600000-e511071d7a792a4a2b16 |
| Source of Spectrum |
U1-2009-3548-10f |
| Wiley ID |
1696942 |
